Benzene and substituted derivatives
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2-Bromo-3-fluorobenzoic Acid 96.0+%, TCI America™
CAS: 132715-69-6 Molecular Formula: C7H4BrFO2 Molecular Weight (g/mol): 219.009 MDL Number: MFCD01569398 InChI Key: KQRCBMPPEPNNDS-UHFFFAOYSA-N Synonym: 3-fluoro-2-bromobenzoic acid,2-bromo-3-fluorobenzoicacid,2-bromo-3-fluoro-benzoic acid,buttpark 22\01-97,benzoic acid, 2-bromo-3-fluoro,pubchem1319,2-bromo-3-fluorobenzoic,acmc-1c0re,intermediates-zcf02016,ksc174c5p PubChem CID: 302622 IUPAC Name: 2-bromo-3-fluorobenzoic acid SMILES: C1=CC(=C(C(=C1)F)Br)C(=O)O
| PubChem CID | 302622 |
|---|---|
| CAS | 132715-69-6 |
| Molecular Weight (g/mol) | 219.009 |
| MDL Number | MFCD01569398 |
| SMILES | C1=CC(=C(C(=C1)F)Br)C(=O)O |
| Synonym | 3-fluoro-2-bromobenzoic acid,2-bromo-3-fluorobenzoicacid,2-bromo-3-fluoro-benzoic acid,buttpark 22\01-97,benzoic acid, 2-bromo-3-fluoro,pubchem1319,2-bromo-3-fluorobenzoic,acmc-1c0re,intermediates-zcf02016,ksc174c5p |
| IUPAC Name | 2-bromo-3-fluorobenzoic acid |
| InChI Key | KQRCBMPPEPNNDS-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrFO2 |
2-Chloro-5-nitrobenzoyl Chloride 98.0+%, TCI America™
CAS: 25784-91-2 Molecular Formula: C7H3Cl2NO3 Molecular Weight (g/mol): 220.005 MDL Number: MFCD00059180 InChI Key: OGLKKYALUKXVPQ-UHFFFAOYSA-N Synonym: 2-chloro-5-nitrobenzoylchloride,benzoyl chloride, 2-chloro-5-nitro,acmc-1cq6z,2-chloro-5nitrobenzoyl chloride,2-chloro-5-nitro-benzoylchlorid,2-chloro-5-nitro-benzoic chloride,2-chloro-5-nitro-benzoyl chloride,benzoyl chloride,2-chloro-5-nitro,2-chloranyl-5-nitro-benzoyl chloride,2-chloro-5-nitrobenzoic acid chloride PubChem CID: 117637 IUPAC Name: 2-chloro-5-nitrobenzoyl chloride SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(=O)Cl)Cl
| PubChem CID | 117637 |
|---|---|
| CAS | 25784-91-2 |
| Molecular Weight (g/mol) | 220.005 |
| MDL Number | MFCD00059180 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C(=O)Cl)Cl |
| Synonym | 2-chloro-5-nitrobenzoylchloride,benzoyl chloride, 2-chloro-5-nitro,acmc-1cq6z,2-chloro-5nitrobenzoyl chloride,2-chloro-5-nitro-benzoylchlorid,2-chloro-5-nitro-benzoic chloride,2-chloro-5-nitro-benzoyl chloride,benzoyl chloride,2-chloro-5-nitro,2-chloranyl-5-nitro-benzoyl chloride,2-chloro-5-nitrobenzoic acid chloride |
| IUPAC Name | 2-chloro-5-nitrobenzoyl chloride |
| InChI Key | OGLKKYALUKXVPQ-UHFFFAOYSA-N |
| Molecular Formula | C7H3Cl2NO3 |
4-Bromo-2-methylbenzoic Acid 98.0+%, TCI America™
CAS: 68837-59-2 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00040905 InChI Key: RVCJOGNLYVNRDN-UHFFFAOYSA-N Synonym: 2-methyl-4-bromobenzoic acid,4-bromo-o-toluic acid,4-bromo-2-methyl-benzoic acid,benzoic acid, 4-bromo-2-methyl,synquest 2721-9-x6,4-bromo-2-methylbenz,4-bromo-2-methylbenzoicacid,pubchem4029,5-bromo-2-carboxytoluene,acmc-1baz5 PubChem CID: 99570 IUPAC Name: 4-bromo-2-methylbenzoic acid SMILES: CC1=C(C=CC(=C1)Br)C(=O)O
| PubChem CID | 99570 |
|---|---|
| CAS | 68837-59-2 |
| Molecular Weight (g/mol) | 215.046 |
| MDL Number | MFCD00040905 |
| SMILES | CC1=C(C=CC(=C1)Br)C(=O)O |
| Synonym | 2-methyl-4-bromobenzoic acid,4-bromo-o-toluic acid,4-bromo-2-methyl-benzoic acid,benzoic acid, 4-bromo-2-methyl,synquest 2721-9-x6,4-bromo-2-methylbenz,4-bromo-2-methylbenzoicacid,pubchem4029,5-bromo-2-carboxytoluene,acmc-1baz5 |
| IUPAC Name | 4-bromo-2-methylbenzoic acid |
| InChI Key | RVCJOGNLYVNRDN-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO2 |
3-Fluoro-4-n-octyloxybenzoic Acid 97.0+%, TCI America™
CAS: 326-78-3 Molecular Formula: C15H21FO3 Molecular Weight (g/mol): 268.328 MDL Number: MFCD00191649 InChI Key: SQVFTDZEUGEJTQ-UHFFFAOYSA-N PubChem CID: 593523 IUPAC Name: 3-fluoro-4-octoxybenzoic acid SMILES: CCCCCCCCOC1=C(C=C(C=C1)C(=O)O)F
| PubChem CID | 593523 |
|---|---|
| CAS | 326-78-3 |
| Molecular Weight (g/mol) | 268.328 |
| MDL Number | MFCD00191649 |
| SMILES | CCCCCCCCOC1=C(C=C(C=C1)C(=O)O)F |
| IUPAC Name | 3-fluoro-4-octoxybenzoic acid |
| InChI Key | SQVFTDZEUGEJTQ-UHFFFAOYSA-N |
| Molecular Formula | C15H21FO3 |
2-Bromo-3-methylbenzoic Acid 98.0+%, TCI America™
CAS: 53663-39-1 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00079721 InChI Key: LSRTWJCYIWGKCQ-UHFFFAOYSA-N Synonym: 2-bromo-3-methyl-benzoic acid,2-bromo-m-toluic acid,2-bromo-3-carboxytoluene,2-bromo-3-methylbenzoicacid,3-methyl-2-bromobenzoic acid,benzoic acid, bromo-3-methyl,2-brom-3-methylbenzoic acid,pubchem3805,acmc-1ay3t,ksc497o4r PubChem CID: 2735588 IUPAC Name: 2-bromo-3-methylbenzoic acid SMILES: CC1=CC=CC(=C1Br)C(=O)O
| PubChem CID | 2735588 |
|---|---|
| CAS | 53663-39-1 |
| Molecular Weight (g/mol) | 215.046 |
| MDL Number | MFCD00079721 |
| SMILES | CC1=CC=CC(=C1Br)C(=O)O |
| Synonym | 2-bromo-3-methyl-benzoic acid,2-bromo-m-toluic acid,2-bromo-3-carboxytoluene,2-bromo-3-methylbenzoicacid,3-methyl-2-bromobenzoic acid,benzoic acid, bromo-3-methyl,2-brom-3-methylbenzoic acid,pubchem3805,acmc-1ay3t,ksc497o4r |
| IUPAC Name | 2-bromo-3-methylbenzoic acid |
| InChI Key | LSRTWJCYIWGKCQ-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO2 |
2,3-Dihydroxybenzoic Acid 98.0+%, TCI America™
CAS: 303-38-8 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.121 MDL Number: MFCD00002446 InChI Key: GLDQAMYCGOIJDV-UHFFFAOYSA-N Synonym: pyrocatechuic acid,o-pyrocatechuic acid,2-pyrocatechuic acid,3-hydroxysalicylic acid,dobk,dhba,2,3-dihydroxybenzoicacid,benzoic acid, 2,3-dihydroxy,catecholcarboxylic acid,2,3-dihydroxy-benzoic acid PubChem CID: 19 ChEBI: CHEBI:18026 IUPAC Name: 2,3-dihydroxybenzoic acid SMILES: C1=CC(=C(C(=C1)O)O)C(=O)O
| PubChem CID | 19 |
|---|---|
| CAS | 303-38-8 |
| Molecular Weight (g/mol) | 154.121 |
| ChEBI | CHEBI:18026 |
| MDL Number | MFCD00002446 |
| SMILES | C1=CC(=C(C(=C1)O)O)C(=O)O |
| Synonym | pyrocatechuic acid,o-pyrocatechuic acid,2-pyrocatechuic acid,3-hydroxysalicylic acid,dobk,dhba,2,3-dihydroxybenzoicacid,benzoic acid, 2,3-dihydroxy,catecholcarboxylic acid,2,3-dihydroxy-benzoic acid |
| IUPAC Name | 2,3-dihydroxybenzoic acid |
| InChI Key | GLDQAMYCGOIJDV-UHFFFAOYSA-N |
| Molecular Formula | C7H6O4 |
| PubChem CID | 22171291 |
|---|---|
| CAS | 603122-80-1 |
| MDL Number | MFCD08689530 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| Synonym | 2-Chloro-4-(methoxycarbonyl)benzeneboronic Acid |
| TSCA | No |
| InChI Key | ITEQHBSWRMYSRP-UHFFFAOYSA-N |
| Molecular Formula | C8H8BClO4 |
| Formula Weight | 214.41 |
Methyl 5-Bromo-2-methylbenzoate 98.0+%, TCI America™
CAS: 79669-50-4 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD09839555 InChI Key: FDCYLMYCHALQJR-UHFFFAOYSA-N Synonym: methyl 5-bromo-2-methyl-benzoate,methyl 5-bromo-o-toluate,methyl5-bromo-2-methylbenzoate,5-bromo-2-methyl-benzoic acid methyl ester,benzoic acid, 5-bromo-2-methyl-, methyl ester,5-bromo-2-methylbenzoic acid methyl ester,5-bromo-2-methylbenzoicacid,methyl 4-bromo-toluate,pubchem10936,acmc-1bhme PubChem CID: 316201 IUPAC Name: methyl 5-bromo-2-methylbenzoate SMILES: CC1=C(C=C(C=C1)Br)C(=O)OC
| PubChem CID | 316201 |
|---|---|
| CAS | 79669-50-4 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD09839555 |
| SMILES | CC1=C(C=C(C=C1)Br)C(=O)OC |
| Synonym | methyl 5-bromo-2-methyl-benzoate,methyl 5-bromo-o-toluate,methyl5-bromo-2-methylbenzoate,5-bromo-2-methyl-benzoic acid methyl ester,benzoic acid, 5-bromo-2-methyl-, methyl ester,5-bromo-2-methylbenzoic acid methyl ester,5-bromo-2-methylbenzoicacid,methyl 4-bromo-toluate,pubchem10936,acmc-1bhme |
| IUPAC Name | methyl 5-bromo-2-methylbenzoate |
| InChI Key | FDCYLMYCHALQJR-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
5-Iodo-o-toluic Acid 98.0+%, TCI America™
CAS: 54811-38-0 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.046 MDL Number: MFCD01570258 InChI Key: WUBHOZQZSHGUFI-UHFFFAOYSA-N Synonym: 5-Iodo-2-methylbenzoic Acid PubChem CID: 621745 IUPAC Name: 5-iodo-2-methylbenzoic acid SMILES: CC1=C(C=C(C=C1)I)C(=O)O
| PubChem CID | 621745 |
|---|---|
| CAS | 54811-38-0 |
| Molecular Weight (g/mol) | 262.046 |
| MDL Number | MFCD01570258 |
| SMILES | CC1=C(C=C(C=C1)I)C(=O)O |
| Synonym | 5-Iodo-2-methylbenzoic Acid |
| IUPAC Name | 5-iodo-2-methylbenzoic acid |
| InChI Key | WUBHOZQZSHGUFI-UHFFFAOYSA-N |
| Molecular Formula | C8H7IO2 |
2-Fluorobenzohydrazide 98.0+%, TCI America™
CAS: 446-24-2 Molecular Formula: C7H7FN2O Molecular Weight (g/mol): 154.14 MDL Number: MFCD00025112 InChI Key: YJCCKQQVXNNAAR-UHFFFAOYSA-N Synonym: 2-fluorobenzhydrazide,2-fluorobenzoic hydrazide,o-fluorobenzhydrazide,2-fluorobenzoic acid hydrazide,2-fluorobenzoylhydrazine,2-fluorobenzenecarbohydrazide,pubchem3481,2-fluoro-benzohydrazide,acmc-209jyw,2-fluoranylbenzohydrazide PubChem CID: 136288 IUPAC Name: 2-fluorobenzohydrazide SMILES: NNC(=O)C1=CC=CC=C1F
| PubChem CID | 136288 |
|---|---|
| CAS | 446-24-2 |
| Molecular Weight (g/mol) | 154.14 |
| MDL Number | MFCD00025112 |
| SMILES | NNC(=O)C1=CC=CC=C1F |
| Synonym | 2-fluorobenzhydrazide,2-fluorobenzoic hydrazide,o-fluorobenzhydrazide,2-fluorobenzoic acid hydrazide,2-fluorobenzoylhydrazine,2-fluorobenzenecarbohydrazide,pubchem3481,2-fluoro-benzohydrazide,acmc-209jyw,2-fluoranylbenzohydrazide |
| IUPAC Name | 2-fluorobenzohydrazide |
| InChI Key | YJCCKQQVXNNAAR-UHFFFAOYSA-N |
| Molecular Formula | C7H7FN2O |
4-Bromobenzamide 98.0+%, TCI America™
CAS: 698-67-9 Molecular Formula: C7H6BrNO Molecular Weight (g/mol): 200.035 MDL Number: MFCD00007991 InChI Key: ZRWNRAJCPNLYAK-UHFFFAOYSA-N Synonym: p-bromobenzamide,benzamide, 4-bromo,benzamide, p-bromo,p-bromobenzoic acid amide,4-bromo-benzamide,4-bromo benzamide,pubchem3737,acmc-209obe,4-bromobenzamide,4-bromobenzoic acid amide PubChem CID: 69683 IUPAC Name: 4-bromobenzamide SMILES: C1=CC(=CC=C1C(=O)N)Br
| PubChem CID | 69683 |
|---|---|
| CAS | 698-67-9 |
| Molecular Weight (g/mol) | 200.035 |
| MDL Number | MFCD00007991 |
| SMILES | C1=CC(=CC=C1C(=O)N)Br |
| Synonym | p-bromobenzamide,benzamide, 4-bromo,benzamide, p-bromo,p-bromobenzoic acid amide,4-bromo-benzamide,4-bromo benzamide,pubchem3737,acmc-209obe,4-bromobenzamide,4-bromobenzoic acid amide |
| IUPAC Name | 4-bromobenzamide |
| InChI Key | ZRWNRAJCPNLYAK-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrNO |
Diatrizoic Acid 98.0+%, TCI America™
CAS: 117-96-4 Molecular Formula: C11H9I3N2O4 Molecular Weight (g/mol): 613.92 MDL Number: MFCD00069960 InChI Key: YVPYQUNUQOZFHG-UHFFFAOYSA-N Synonym: diatrizoic acid,amidotrizoic acid,diatrizoate,amidotrizoate,urogranoic acid,urografin acid,odiston,urotrast,diat,diatriazoate PubChem CID: 2140 ChEBI: CHEBI:53691 IUPAC Name: 3,5-diacetamido-2,4,6-triiodobenzoic acid SMILES: CC(=O)NC1=C(I)C(C(O)=O)=C(I)C(NC(C)=O)=C1I
| PubChem CID | 2140 |
|---|---|
| CAS | 117-96-4 |
| Molecular Weight (g/mol) | 613.92 |
| ChEBI | CHEBI:53691 |
| MDL Number | MFCD00069960 |
| SMILES | CC(=O)NC1=C(I)C(C(O)=O)=C(I)C(NC(C)=O)=C1I |
| Synonym | diatrizoic acid,amidotrizoic acid,diatrizoate,amidotrizoate,urogranoic acid,urografin acid,odiston,urotrast,diat,diatriazoate |
| IUPAC Name | 3,5-diacetamido-2,4,6-triiodobenzoic acid |
| InChI Key | YVPYQUNUQOZFHG-UHFFFAOYSA-N |
| Molecular Formula | C11H9I3N2O4 |
2,3,4,5-Tetrafluorobenzoyl Chloride 97.0+%, TCI America™
CAS: 94695-48-4 Molecular Formula: C7HClF4O Molecular Weight (g/mol): 212.53 MDL Number: MFCD00075164 InChI Key: XWCKIXLTBNGIHV-UHFFFAOYSA-N Synonym: 2,3,4,5-tetrafluorobenzoylchloride,tetrafluorobenzoyl chloride,2,3,4,5-tetrafluoro benzoyl chloride,benzoyl chloride, 2,3,4,5-tetrafluoro,2,3,4,5-tetrafluorbenzoylchlorid,2,3,4,5-tetrafluoro-benzoyl chloride,2,3,4,5-tetrafluorobenzoic acid chloride,2,3,4,5-tetrafluorobezoyl chloride,benzoyl chloride, 2,3,4,5-tetrafluoro-9ci,2,3,4,5-tetrafluorobezoylchloride PubChem CID: 2733689 IUPAC Name: 2,3,4,5-tetrafluorobenzoyl chloride SMILES: FC1=CC(C(Cl)=O)=C(F)C(F)=C1F
| PubChem CID | 2733689 |
|---|---|
| CAS | 94695-48-4 |
| Molecular Weight (g/mol) | 212.53 |
| MDL Number | MFCD00075164 |
| SMILES | FC1=CC(C(Cl)=O)=C(F)C(F)=C1F |
| Synonym | 2,3,4,5-tetrafluorobenzoylchloride,tetrafluorobenzoyl chloride,2,3,4,5-tetrafluoro benzoyl chloride,benzoyl chloride, 2,3,4,5-tetrafluoro,2,3,4,5-tetrafluorbenzoylchlorid,2,3,4,5-tetrafluoro-benzoyl chloride,2,3,4,5-tetrafluorobenzoic acid chloride,2,3,4,5-tetrafluorobezoyl chloride,benzoyl chloride, 2,3,4,5-tetrafluoro-9ci,2,3,4,5-tetrafluorobezoylchloride |
| IUPAC Name | 2,3,4,5-tetrafluorobenzoyl chloride |
| InChI Key | XWCKIXLTBNGIHV-UHFFFAOYSA-N |
| Molecular Formula | C7HClF4O |
| Molecular Weight (g/mol) | 197.956 |
|---|---|
| Color | White |
| Physical Form | Crystalline Powder |
| Chemical Name or Material | 3-Fluoro-4-(methoxycarbonyl)phenylboronic Acid (contains varying amounts of Anhydride) |
| SMILES | B(C1=CC(=C(C=C1)C(=O)OC)F)(O)O |
| InChI Key | YZYGXFXSMDUXJT-UHFFFAOYSA-N |
| PubChem CID | 2782818 |
| CAS | 505083-04-5 |
| MDL Number | MFCD04115665 |
| TSCA | No |
| IUPAC Name | (3-fluoro-4-methoxycarbonylphenyl)boronic acid |
| Molecular Formula | C8H8BFO4 |
| Formula Weight | 197.96 |
| Melting Point | 184°C |
2-Chloro-4-fluorobenzoic Acid 98.0+%, TCI America™
CAS: 2252-51-9 Molecular Formula: C7H4ClFO2 Molecular Weight (g/mol): 174.555 MDL Number: MFCD00010615 InChI Key: GRPWQLDSGNZEQE-UHFFFAOYSA-N Synonym: benzoic acid, 2-chloro-4-fluoro,2-chloro-4-fluoro-benzoic acid,2-chloro-4-fluor obenzoic acid,pubchem1370,acmc-209fx5,ksc207e4n,rarechem al bo 0405,2-chloro 4-fluoro benzoic acid,2-chloro-4-fluoro benzoic acid,4-fluoro-2-chloro-benzoic acid PubChem CID: 75259 IUPAC Name: 2-chloro-4-fluorobenzoic acid SMILES: C1=CC(=C(C=C1F)Cl)C(=O)O
| PubChem CID | 75259 |
|---|---|
| CAS | 2252-51-9 |
| Molecular Weight (g/mol) | 174.555 |
| MDL Number | MFCD00010615 |
| SMILES | C1=CC(=C(C=C1F)Cl)C(=O)O |
| Synonym | benzoic acid, 2-chloro-4-fluoro,2-chloro-4-fluoro-benzoic acid,2-chloro-4-fluor obenzoic acid,pubchem1370,acmc-209fx5,ksc207e4n,rarechem al bo 0405,2-chloro 4-fluoro benzoic acid,2-chloro-4-fluoro benzoic acid,4-fluoro-2-chloro-benzoic acid |
| IUPAC Name | 2-chloro-4-fluorobenzoic acid |
| InChI Key | GRPWQLDSGNZEQE-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClFO2 |